#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtn s SER 2 N 0.00 5.39 -0.05 4.04 0.01 -1.26 -5.01 113.70 116.82 2jtn s SER 2 Ca 0.00 1.07 0.06 0.00 1.31 0.00 0.00 55.95 58.38 2jtn s SER 2 Cb 0.00 -1.86 0.13 0.00 0.21 0.00 0.00 66.02 64.50 2jtn s SER 2 CO 0.00 -1.36 1.10 0.00 0.41 0.00 0.00 173.24 173.38 2jtn n GLN 3 N -2.99 0.21 -3.62 12.44 0.00 -1.26 -5.03 117.38 117.12 2jtn n GLN 3 Ca 0.07 -1.23 -0.28 0.00 0.00 0.00 0.00 57.00 55.56 2jtn n GLN 3 Cb 0.58 0.37 -0.11 0.00 0.00 0.00 0.00 30.24 31.07 2jtn n GLN 3 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 2jtn s VAL 4 N -0.08 1.43 0.00 -0.39 -7.23 -1.26 -5.12 120.40 107.75 2jtn s VAL 4 Ca 0.07 -3.26 0.00 0.00 -1.81 0.00 0.00 61.98 56.98 2jtn s VAL 4 Cb 0.12 -1.96 0.00 0.00 0.56 0.00 0.00 36.38 35.10 2jtn s VAL 4 CO -0.04 -1.11 0.00 -0.81 -0.31 0.00 0.00 175.10 172.83 2jtn n PRO 5 N 2.59 -0.56 -1.56 4.82 -0.04 -1.26 -4.83 135.00 134.16 2jtn n PRO 5 Ca 0.23 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.32 2jtn n PRO 5 Cb 0.41 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.84 2jtn n PRO 5 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2jtn n ASP 6 N -2.40 2.54 -4.47 3.54 8.00 -1.26 -4.93 116.55 117.56 2jtn n ASP 6 Ca 0.00 -0.33 -0.25 0.00 0.71 0.00 0.00 54.79 54.93 2jtn n ASP 6 Cb 0.00 -1.57 -0.10 0.00 -0.02 0.00 0.00 41.12 39.42 2jtn n ASP 6 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jtn s VAL 7 N 11.24 2.48 0.31 2.53 0.11 -1.26 -4.64 120.40 131.17 2jtn s VAL 7 Ca 0.99 -2.30 -0.07 0.00 -2.93 0.00 0.00 61.98 57.67 2jtn s VAL 7 Cb -0.23 -2.28 0.03 0.00 -1.53 0.00 0.00 36.38 32.37 2jtn s VAL 7 CO 0.29 -0.33 0.54 0.23 -3.33 0.00 0.00 175.10 172.49 2jtn n MET 8 N -0.42 0.78 -3.68 1.54 0.00 -1.25 -5.09 117.12 108.99 2jtn n MET 8 Ca -0.07 -2.10 -0.12 0.00 0.00 0.00 0.00 57.70 55.41 2jtn n MET 8 Cb 0.59 2.30 -0.09 0.00 0.00 0.00 0.00 33.22 36.02 2jtn n MET 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2jtn s VAL 9 N -2.50 -0.01 0.49 2.03 0.11 -1.26 -2.89 120.40 116.38 2jtn s VAL 9 Ca 0.19 0.02 -0.22 0.00 -2.93 0.00 0.00 61.98 59.04 2jtn s VAL 9 Cb -0.03 -0.76 -0.09 0.00 -1.53 0.00 0.00 36.38 33.98 2jtn s VAL 9 CO 0.14 0.01 0.93 0.52 -3.33 0.00 0.00 175.10 173.36 2jtn n VAL 10 N 3.34 2.77 -0.81 2.04 0.31 0.27 -4.77 118.33 121.48 2jtn n VAL 10 Ca -0.17 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 2jtn n VAL 10 Cb 0.56 -1.09 0.00 0.00 -0.91 0.00 0.00 33.84 32.41 2jtn n VAL 10 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jtn n GLY 11 N 1.30 5.52 3.66 2.92 0.00 -1.26 0.54 105.19 117.86 2jtn n GLY 11 Ca 0.11 -0.97 -0.43 0.00 0.00 0.00 0.00 46.02 44.73 2jtn n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jtn s GLU 12 N 3.76 4.24 0.36 1.61 2.02 -1.26 -4.12 118.70 125.32 2jtn s GLU 12 Ca 0.00 1.58 -0.28 0.00 0.02 0.00 0.00 54.97 56.29 2jtn s GLU 12 Cb 0.00 -3.73 -0.11 0.00 0.10 0.00 0.00 34.13 30.40 2jtn s GLU 12 CO 0.00 -0.68 1.42 -2.14 0.02 0.00 0.00 175.26 173.88 2jtn s PRO 13 N 3.38 4.19 0.21 0.39 0.02 -1.26 -4.91 135.00 137.02 2jtn s PRO 13 Ca 0.52 2.44 -0.21 0.00 0.02 0.00 0.00 61.00 63.76 2jtn s PRO 13 Cb -0.20 -3.00 0.04 0.00 0.02 0.00 0.00 34.50 31.37 2jtn s PRO 13 CO 0.12 -0.42 0.64 -0.08 -0.33 0.00 0.00 177.00 176.93 2jtn s THR 14 N -1.13 0.00 0.27 0.99 -1.32 0.35 -4.48 115.64 110.32 2jtn s THR 14 Ca 0.52 -0.50 0.02 0.00 -1.21 0.00 0.00 61.69 60.52 2jtn s THR 14 Cb -0.44 -1.47 -0.04 0.00 -1.51 0.00 0.00 72.50 69.04 2jtn s THR 14 CO 0.59 -0.02 0.17 -0.76 -2.21 0.00 0.00 174.62 172.39 2jtn s LEU 15 N -2.83 1.50 0.38 9.08 1.43 -1.26 -3.70 118.68 123.28 2jtn s LEU 15 Ca 0.06 -1.52 0.14 0.00 -1.03 0.00 0.00 54.13 51.78 2jtn s LEU 15 Cb -0.03 0.32 0.75 0.00 0.03 0.00 0.00 46.19 47.26 2jtn s LEU 15 CO -0.04 -0.89 1.82 0.00 0.23 0.00 0.00 176.35 177.47 2jtn h MET 16 N 2.36 0.00 -5.48 1.70 -0.00 -1.90 -3.48 114.93 108.12 2jtn h MET 16 Ca -0.33 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.34 2jtn h MET 16 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.85 2jtn h MET 16 CO 0.50 0.37 -0.91 0.41 -0.00 0.00 0.00 176.91 177.27 2jtn n GLY 17 N -0.37 -2.66 3.53 -3.00 0.00 0.32 -4.94 105.19 98.06 2jtn n GLY 17 Ca -0.02 0.59 -0.01 0.00 0.00 0.00 0.00 46.02 46.59 2jtn n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jtn s GLY 18 N -1.71 -0.19 -0.25 -0.02 0.00 -1.00 -4.84 107.32 99.32 2jtn s GLY 18 Ca 0.08 2.99 0.13 0.00 0.00 0.00 0.00 44.72 47.92 2jtn s GLY 18 CO 0.65 2.94 1.58 1.18 0.00 0.00 0.00 173.10 179.45 2jtn n GLU 19 N 4.50 3.20 -1.22 2.90 4.71 -1.26 -4.56 120.64 128.91 2jtn n GLU 19 Ca -0.13 -3.01 0.17 0.00 -0.01 0.00 0.00 57.16 54.17 2jtn n GLU 19 Cb 0.54 -2.00 -0.04 0.00 -1.01 0.00 0.00 31.44 28.94 2jtn n GLU 19 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2jtn n PHE 20 N -0.39 -3.39 -3.92 -0.32 7.35 -1.26 -4.92 117.46 110.61 2jtn n PHE 20 Ca 0.30 1.51 -0.16 0.00 -0.76 0.00 0.00 57.45 58.35 2jtn n PHE 20 Cb 1.10 -2.80 -0.15 0.00 0.35 0.00 0.00 39.48 37.97 2jtn n PHE 20 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2jtn s GLY 21 N -6.36 0.17 0.51 7.13 0.00 -1.26 -5.02 107.32 102.49 2jtn s GLY 21 Ca 0.00 0.12 0.18 0.00 0.00 0.00 0.00 44.72 45.01 2jtn s GLY 21 CO 0.00 0.41 2.09 -0.55 0.00 0.00 0.00 173.10 175.05 2jtn h ASP 22 N 6.90 0.06 -0.02 1.64 3.32 -1.91 -0.56 116.42 125.85 2jtn h ASP 22 Ca -0.38 -0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.67 2jtn h ASP 22 Cb 1.15 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 2jtn h ASP 22 CO 0.49 0.04 0.02 -0.33 -1.72 0.00 0.00 179.24 177.74 2jtn h GLU 23 N 0.07 0.00 0.14 3.56 5.08 -1.98 -3.12 114.58 118.32 2jtn h GLU 23 Ca 0.10 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2jtn h GLU 23 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2jtn h GLU 23 CO -0.01 0.00 -0.08 0.22 -1.00 0.00 0.00 179.01 178.14 2jtn h ASP 24 N 0.00 -0.19 -1.71 1.42 1.82 -1.52 -3.45 116.42 112.79 2jtn h ASP 24 Ca 0.01 0.01 -0.46 0.00 -0.39 0.00 0.00 57.03 56.20 2jtn h ASP 24 Cb 0.05 0.05 0.05 0.00 0.68 0.00 0.00 39.33 40.17 2jtn h ASP 24 CO -0.00 -0.12 -0.01 -1.61 -1.61 0.00 0.00 179.24 175.88 2jtn s GLU 25 N -3.46 2.11 0.35 0.28 0.41 -1.18 -5.08 118.70 112.14 2jtn s GLU 25 Ca -0.03 -1.24 -0.26 0.00 -0.41 0.00 0.00 54.97 53.03 2jtn s GLU 25 Cb 0.00 -2.49 -0.09 0.00 -1.78 0.00 0.00 34.13 29.77 2jtn s GLU 25 CO 0.09 -1.04 1.02 -0.98 -0.49 0.00 0.00 175.26 173.86 2jtn s ARG 26 N -4.86 4.42 0.34 1.61 1.70 -1.26 -4.87 118.95 116.03 2jtn s ARG 26 Ca 0.62 1.49 0.08 0.00 -0.47 0.00 0.00 55.73 57.46 2jtn s ARG 26 Cb -0.07 -2.77 -0.04 0.00 -0.57 0.00 0.00 34.95 31.50 2jtn s ARG 26 CO 0.41 0.09 0.13 -1.17 -1.08 0.00 0.00 175.30 173.68 2jtn s LEU 27 N -2.17 3.23 0.81 -1.89 2.96 -1.26 -3.88 118.68 116.48 2jtn s LEU 27 Ca 0.52 -0.80 -0.12 0.00 -0.22 0.00 0.00 54.13 53.51 2jtn s LEU 27 Cb -0.23 -1.70 0.09 0.00 0.50 0.00 0.00 46.19 44.85 2jtn s LEU 27 CO 0.29 -0.30 1.16 -0.63 -1.32 0.00 0.00 176.35 175.55 2jtn s ILE 28 N -2.44 2.37 -0.27 6.68 -1.09 -1.25 -4.82 121.20 120.38 2jtn s ILE 28 Ca 0.37 0.14 0.01 0.00 -2.23 0.00 0.00 60.65 58.95 2jtn s ILE 28 Cb -0.02 -2.46 0.07 0.00 -1.58 0.00 0.00 42.46 38.47 2jtn s ILE 28 CO 0.22 -0.13 -0.02 -0.89 -1.23 0.00 0.00 174.94 172.89 2jtn s THR 29 N -2.41 1.66 -0.64 2.92 2.01 -0.68 -4.97 115.64 113.52 2jtn s THR 29 Ca 0.69 -1.50 -0.24 0.00 0.31 0.00 0.00 61.69 60.95 2jtn s THR 29 Cb -0.24 -2.00 0.05 0.00 0.01 0.00 0.00 72.50 70.32 2jtn s THR 29 CO 0.52 -0.25 1.05 -0.13 -0.69 0.00 0.00 174.62 175.11 2jtn s ARG 30 N 1.30 3.21 0.02 4.92 3.00 -1.26 -1.71 118.95 128.42 2jtn s ARG 30 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 55.73 55.24 2jtn s ARG 30 Cb -0.19 -4.16 -0.02 0.00 0.00 0.00 0.00 34.95 30.58 2jtn s ARG 30 CO -0.09 -1.80 -0.03 -0.48 0.00 0.00 0.00 175.30 172.90 2jtn s LEU 31 N 4.48 2.23 0.37 2.53 0.05 -1.16 -5.07 118.68 122.11 2jtn s LEU 31 Ca 0.28 -0.48 -0.25 0.00 0.05 0.00 0.00 54.13 53.73 2jtn s LEU 31 Cb -0.13 0.08 -0.09 0.00 -2.05 0.00 0.00 46.19 43.99 2jtn s LEU 31 CO 0.15 -0.28 1.01 -1.61 -0.55 0.00 0.00 176.35 175.06 2jtn s GLU 32 N -1.41 4.35 -0.08 1.48 2.02 -1.26 -2.83 118.70 120.97 2jtn s GLU 32 Ca -0.15 1.44 0.11 0.00 0.02 0.00 0.00 54.97 56.38 2jtn s GLU 32 Cb -0.10 -2.65 -0.16 0.00 0.10 0.00 0.00 34.13 31.33 2jtn s GLU 32 CO -0.01 0.04 0.12 0.09 0.02 0.00 0.00 175.26 175.52 2jtn n ASN 33 N 0.19 2.23 -3.57 -0.19 4.13 0.60 -4.92 115.26 113.74 2jtn n ASN 33 Ca 0.04 0.00 -0.25 0.00 1.68 0.00 0.00 54.58 56.05 2jtn n ASN 33 Cb 0.50 1.05 -0.02 0.00 -1.54 0.00 0.00 39.78 39.76 2jtn n ASN 33 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 2jtn n THR 34 N -2.24 -0.58 -1.64 3.41 5.66 -1.25 -4.81 114.28 112.82 2jtn n THR 34 Ca -0.13 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.73 2jtn n THR 34 Cb 0.67 -1.18 0.12 0.00 -1.55 0.00 0.00 70.33 68.40 2jtn n THR 34 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2jtn n GLN 35 N -3.64 2.52 0.04 1.09 6.02 -1.26 -4.81 117.38 117.33 2jtn n GLN 35 Ca 0.03 -3.54 -0.02 0.00 -0.01 0.00 0.00 57.00 53.47 2jtn n GLN 35 Cb 0.51 -2.02 -0.01 0.00 1.02 0.00 0.00 30.24 29.74 2jtn n GLN 35 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2jtn h PHE 36 N 1.53 -0.10 -0.41 1.08 3.04 -1.87 -3.34 116.94 116.87 2jtn h PHE 36 Ca 0.31 -0.00 -0.37 0.00 3.98 0.00 0.00 57.97 61.89 2jtn h PHE 36 Cb 1.46 0.03 -0.03 0.00 2.56 0.00 0.00 35.95 39.97 2jtn h PHE 36 CO 1.03 -0.06 1.21 -3.47 -2.02 0.00 0.00 178.31 175.00 2jtn n ASP 37 N -2.31 3.03 -0.03 0.41 -0.08 -1.26 -4.35 116.55 111.95 2jtn n ASP 37 Ca -0.01 -2.70 -0.04 0.00 -1.51 0.00 0.00 54.79 50.53 2jtn n ASP 37 Cb 0.04 -1.67 -0.03 0.00 2.34 0.00 0.00 41.12 41.80 2jtn n ASP 37 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jtn n ALA 38 N 13.63 1.88 -3.15 -1.67 0.00 -1.25 -5.04 120.51 124.91 2jtn n ALA 38 Ca 0.45 -0.24 0.06 0.00 0.00 0.00 0.00 53.44 53.71 2jtn n ALA 38 Cb 0.46 0.36 -0.01 0.00 0.00 0.00 0.00 19.45 20.25 2jtn n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn s ALA 39 N -2.11 -3.71 0.00 0.00 0.00 -1.26 -5.04 121.76 109.64 2jtn s ALA 39 Ca -0.07 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.27 2jtn s ALA 39 Cb 0.02 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.53 2jtn s ALA 39 CO 0.13 -1.63 0.00 0.09 0.00 0.00 0.00 175.76 174.36 2jtn n ASN 40 N 5.39 0.00 0.00 0.00 5.03 -1.26 -4.88 115.26 119.54 2jtn n ASN 40 Ca -0.04 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.41 2jtn n ASN 40 Cb 0.55 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.31 2jtn n ASN 40 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jtn n GLY 41 N 0.00 1.58 0.11 7.41 0.00 -1.26 -3.96 105.19 109.07 2jtn n GLY 41 Ca 0.00 -0.61 -0.20 0.00 0.00 0.00 0.00 46.02 45.21 2jtn n GLY 41 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jtn h ILE 42 N 0.00 1.27 -4.17 -0.61 5.03 -1.96 -3.47 117.51 113.60 2jtn h ILE 42 Ca 0.00 -2.37 -0.50 0.00 -0.12 0.00 0.00 64.86 61.87 2jtn h ILE 42 Cb 0.00 2.86 0.14 0.00 -3.03 0.00 0.00 36.82 36.79 2jtn h ILE 42 CO 0.00 0.61 0.28 -1.81 -0.68 0.00 0.00 178.15 176.54 2jtn s ASP 43 N -6.80 3.87 0.05 1.72 1.11 -1.25 -5.07 116.67 110.29 2jtn s ASP 43 Ca -0.20 1.65 -0.03 0.00 0.18 0.00 0.00 52.55 54.15 2jtn s ASP 43 Cb 0.02 -2.33 -0.02 0.00 1.07 0.00 0.00 42.92 41.66 2jtn s ASP 43 CO 0.72 -2.41 0.04 -1.81 1.18 0.00 0.00 175.17 172.89 2jtn s ASP 44 N -3.38 0.30 0.48 0.27 1.01 -1.26 -4.83 116.67 109.27 2jtn s ASP 44 Ca 0.63 -0.72 -0.21 0.00 0.71 0.00 0.00 52.55 52.95 2jtn s ASP 44 Cb -0.18 0.21 -0.08 0.00 1.01 0.00 0.00 42.92 43.89 2jtn s ASP 44 CO 0.57 -0.54 1.08 -0.70 0.21 0.00 0.00 175.17 175.78 2jtn s GLU 45 N -3.11 3.75 0.05 8.23 2.56 -1.26 -5.06 118.70 123.86 2jtn s GLU 45 Ca -0.01 1.49 0.01 0.00 0.00 0.00 0.00 54.97 56.46 2jtn s GLU 45 Cb 0.02 -2.18 -0.03 0.00 2.00 0.00 0.00 34.13 33.94 2jtn s GLU 45 CO -0.07 -0.50 -0.05 0.20 -0.56 0.00 0.00 175.26 174.28 2jtn s GLY 46 N -1.79 0.47 0.04 -1.50 0.00 -1.26 -5.02 107.32 98.26 2jtn s GLY 46 Ca 0.67 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 44.46 2jtn s GLY 46 CO 0.24 -1.00 0.00 0.61 0.00 0.00 0.00 173.10 172.95 2jtn n GLY 47 N 0.92 -1.55 0.81 0.20 0.00 -1.26 -5.08 105.19 99.22 2jtn n GLY 47 Ca -0.19 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2jtn n GLY 47 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jtn n SER 48 N -2.89 0.00 -0.01 1.61 7.64 -1.26 -5.07 113.62 113.64 2jtn n SER 48 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 2jtn n SER 48 Cb 0.00 0.20 -0.01 0.00 -1.01 0.00 0.00 64.21 63.40 2jtn n SER 48 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jtn n GLY 49 N -1.22 -0.35 0.00 0.23 0.00 -1.26 -5.15 105.19 97.43 2jtn n GLY 49 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2jtn n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtn n GLY 50 N 1.99 -0.64 3.89 -0.02 0.00 -1.26 -5.13 105.19 104.01 2jtn n GLY 50 Ca -0.03 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.22 2jtn n GLY 50 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jtn s HIS 51 N -3.62 2.88 -0.24 1.61 3.76 -1.26 -5.07 115.29 113.35 2jtn s HIS 51 Ca 0.00 -0.34 -0.20 0.00 -0.15 0.00 0.00 55.06 54.37 2jtn s HIS 51 Cb 0.00 -1.94 -0.02 0.00 1.11 0.00 0.00 32.58 31.73 2jtn s HIS 51 CO 0.00 0.05 0.59 -1.64 -0.85 0.00 0.00 174.74 172.90 2jtn s MET 52 N -4.07 4.13 -1.05 1.40 -1.94 -1.26 -3.96 119.30 112.55 2jtn s MET 52 Ca 0.44 0.50 0.00 0.00 -1.71 0.00 0.00 55.69 54.92 2jtn s MET 52 Cb -0.06 -3.63 0.00 0.00 2.01 0.00 0.00 34.83 33.15 2jtn s MET 52 CO 0.28 -0.35 0.00 0.41 -0.01 0.00 0.00 175.02 175.35 2jtn n GLY 53 N 4.13 0.08 1.45 -0.03 0.00 -1.26 -4.78 105.19 104.79 2jtn n GLY 53 Ca -0.02 -0.40 0.19 0.00 0.00 0.00 0.00 46.02 45.78 2jtn n GLY 53 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jtn n SER 54 N -0.21 -8.65 -2.14 1.61 7.64 -1.25 -5.05 113.62 105.57 2jtn n SER 54 Ca -0.14 1.09 -0.08 0.00 1.01 0.00 0.00 58.87 60.75 2jtn n SER 54 Cb 0.58 -4.73 -0.01 0.00 -1.01 0.00 0.00 64.21 59.03 2jtn n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jtn n GLY 55 N -4.33 2.41 0.00 0.23 0.00 -1.26 -4.99 105.19 97.25 2jtn n GLY 55 Ca -0.05 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2jtn n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtn n GLY 56 N -0.33 0.89 3.25 -0.02 0.00 -1.26 -4.99 105.19 102.74 2jtn n GLY 56 Ca -0.00 -1.96 -0.44 0.00 0.00 0.00 0.00 46.02 43.62 2jtn n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jtn s THR 57 N -2.34 5.03 0.93 2.61 2.01 -1.26 -5.07 115.64 117.55 2jtn s THR 57 Ca 0.00 -2.69 -0.11 0.00 0.31 0.00 0.00 61.69 59.19 2jtn s THR 57 Cb 0.00 -4.14 0.15 0.00 0.01 0.00 0.00 72.50 68.52 2jtn s THR 57 CO 0.00 -0.99 1.09 -2.16 -0.69 0.00 0.00 174.62 171.87 2jtn s PRO 58 N -0.00 1.00 -1.68 4.92 0.04 -1.26 -3.57 135.00 134.45 2jtn s PRO 58 Ca 0.18 0.95 -0.01 0.00 0.04 0.00 0.00 61.00 62.16 2jtn s PRO 58 Cb -0.13 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.64 2jtn s PRO 58 CO -0.07 -2.45 0.07 0.39 0.04 0.00 0.00 177.00 174.98 2jtn n GLU 59 N -4.05 -2.12 -4.16 4.56 -0.58 -1.26 -4.97 120.64 108.06 2jtn n GLU 59 Ca 0.07 0.95 -0.35 0.00 -0.42 0.00 0.00 57.16 57.41 2jtn n GLU 59 Cb 0.54 -5.64 -0.09 0.00 -0.57 0.00 0.00 31.44 25.69 2jtn n GLU 59 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 2jtn s ILE 60 N -3.01 4.65 0.11 -3.67 1.10 -1.23 -5.06 121.20 114.08 2jtn s ILE 60 Ca 0.04 -0.10 -0.32 0.00 -0.51 0.00 0.00 60.65 59.75 2jtn s ILE 60 Cb -0.02 -3.03 -0.12 0.00 0.15 0.00 0.00 42.46 39.45 2jtn s ILE 60 CO 0.05 0.54 1.78 -0.81 -2.11 0.00 0.00 174.94 174.39 2jtn n PRO 61 N 2.76 2.55 -3.31 3.50 -0.04 -1.26 -4.83 135.00 134.37 2jtn n PRO 61 Ca -0.18 0.93 -0.38 0.00 -0.04 0.00 0.00 63.50 63.82 2jtn n PRO 61 Cb 0.53 -2.78 -0.06 0.00 -0.04 0.00 0.00 33.50 31.15 2jtn n PRO 61 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2jtn s MET 62 N 2.39 4.17 1.04 0.54 -1.94 -1.26 -3.86 119.30 120.37 2jtn s MET 62 Ca 0.82 0.66 -0.13 0.00 -1.71 0.00 0.00 55.69 55.33 2jtn s MET 62 Cb -0.56 -3.26 0.17 0.00 2.01 0.00 0.00 34.83 33.18 2jtn s MET 62 CO 0.39 0.58 0.81 0.00 -0.01 0.00 0.00 175.02 176.79 2jtn s ALA 64 N -2.46 3.42 0.00 0.00 0.00 -1.23 -4.41 121.76 117.07 2jtn s ALA 64 Ca 0.64 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2jtn s ALA 64 Cb -0.22 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.38 2jtn s ALA 64 CO 0.63 -1.56 0.00 0.41 0.00 0.00 0.00 175.76 175.24 2jtn n GLY 65 N 4.36 2.31 3.90 0.00 0.00 -1.26 -3.97 105.19 110.52 2jtn n GLY 65 Ca 0.07 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 45.11 2jtn n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jtn s ASP 67 N -3.08 5.96 -0.30 0.00 2.15 -1.26 -4.30 116.67 115.84 2jtn s ASP 67 Ca 0.45 -1.25 -0.21 0.00 0.43 0.00 0.00 52.55 51.98 2jtn s ASP 67 Cb -0.11 -2.57 0.20 0.00 -0.30 0.00 0.00 42.92 40.15 2jtn s ASP 67 CO 0.29 -2.01 1.35 -1.58 -0.17 0.00 0.00 175.17 173.05 2jtn s GLN 68 N 5.73 0.06 0.41 4.34 0.74 -1.26 -5.01 119.66 124.67 2jtn s GLN 68 Ca 0.56 0.08 -0.24 0.00 0.05 0.00 0.00 55.36 55.81 2jtn s GLN 68 Cb -0.02 0.02 -0.08 0.00 1.10 0.00 0.00 33.01 34.02 2jtn s GLN 68 CO -0.04 -0.01 1.12 -3.38 -0.55 0.00 0.00 175.29 172.43 2jtn s HIS 69 N 0.53 3.11 0.59 1.67 0.00 -1.25 0.93 115.29 120.87 2jtn s HIS 69 Ca -0.00 1.59 -0.17 0.00 -3.00 0.00 0.00 55.06 53.48 2jtn s HIS 69 Cb -0.04 -3.28 -0.04 0.00 -4.00 0.00 0.00 32.58 25.22 2jtn s HIS 69 CO -0.13 -1.08 1.08 0.42 -1.00 0.00 0.00 174.74 174.04 2jtn s ILE 70 N -1.53 3.53 -0.06 -5.38 -1.09 -1.25 -4.72 121.20 110.70 2jtn s ILE 70 Ca 0.59 0.79 0.02 0.00 -2.23 0.00 0.00 60.65 59.82 2jtn s ILE 70 Cb -0.27 -3.29 0.07 0.00 -1.58 0.00 0.00 42.46 37.39 2jtn s ILE 70 CO 0.33 -0.37 0.60 0.00 -1.23 0.00 0.00 174.94 174.28 2jtn n LEU 71 N -1.87 -0.38 -4.51 2.97 -0.00 -1.26 -5.02 117.00 106.92 2jtn n LEU 71 Ca 0.10 -1.23 -0.33 0.00 -0.00 0.00 0.00 56.01 54.55 2jtn n LEU 71 Cb 0.52 0.44 -0.12 0.00 -0.00 0.00 0.00 43.42 44.26 2jtn n LEU 71 CO 0.45 1.05 -0.41 -1.81 -0.00 0.00 0.00 177.39 176.67 2jtn s ASP 72 N -0.32 4.37 0.43 1.45 1.11 -1.26 -3.58 116.67 118.87 2jtn s ASP 72 Ca 0.02 -0.12 0.15 0.00 0.18 0.00 0.00 52.55 52.77 2jtn s ASP 72 Cb 0.08 -1.15 1.04 0.00 1.07 0.00 0.00 42.92 43.96 2jtn s ASP 72 CO -0.02 0.32 1.94 0.08 1.18 0.00 0.00 175.17 178.67 2jtn h ARG 73 N 5.55 0.41 -4.54 8.23 -0.00 -1.92 -3.36 114.38 118.73 2jtn h ARG 73 Ca -0.44 -0.02 -0.71 0.00 -0.00 0.00 0.00 59.98 58.81 2jtn h ARG 73 Cb 1.17 -0.09 -0.27 0.00 -0.00 0.00 0.00 29.97 30.78 2jtn h ARG 73 CO 0.53 0.27 -0.51 -0.06 -0.00 0.00 0.00 179.97 180.19 2jtn s PHE 74 N -5.41 3.29 0.16 4.08 0.40 -1.26 -0.29 117.98 118.94 2jtn s PHE 74 Ca -0.08 -1.32 0.09 0.00 -0.60 0.00 0.00 56.93 55.03 2jtn s PHE 74 Cb 0.20 -2.64 -0.04 0.00 0.51 0.00 0.00 43.02 41.06 2jtn s PHE 74 CO 0.76 -0.76 -0.21 0.42 0.70 0.00 0.00 175.22 176.14 2jtn s ILE 75 N 1.46 1.95 -0.32 0.64 -1.09 -1.13 -4.85 121.20 117.87 2jtn s ILE 75 Ca 0.02 -1.85 -0.01 0.00 -2.23 0.00 0.00 60.65 56.57 2jtn s ILE 75 Cb -0.21 -1.86 0.07 0.00 -1.58 0.00 0.00 42.46 38.88 2jtn s ILE 75 CO 0.04 -0.18 0.04 -0.76 -1.23 0.00 0.00 174.94 172.85 2jtn s LEU 76 N -2.45 4.24 -0.21 2.97 1.02 -1.25 -2.97 118.68 120.03 2jtn s LEU 76 Ca 0.15 -1.52 -0.19 0.00 0.02 0.00 0.00 54.13 52.58 2jtn s LEU 76 Cb -0.07 -1.72 -0.03 0.00 0.02 0.00 0.00 46.19 44.39 2jtn s LEU 76 CO 0.07 -0.33 0.57 -0.75 0.02 0.00 0.00 176.35 175.93 2jtn s LYS 77 N 1.19 4.18 0.22 1.70 2.20 -0.69 -1.67 119.74 126.86 2jtn s LYS 77 Ca -0.01 0.49 -0.16 0.00 -0.36 0.00 0.00 55.97 55.93 2jtn s LYS 77 Cb -0.20 -3.58 0.01 0.00 -1.51 0.00 0.00 37.83 32.54 2jtn s LYS 77 CO -0.03 -0.23 0.51 0.00 -0.36 0.00 0.00 175.35 175.25 2jtn s ALA 78 N 1.88 -0.66 -1.51 3.13 0.00 0.15 -1.69 121.76 123.07 2jtn s ALA 78 Ca 0.26 -0.50 -0.05 0.00 0.00 0.00 0.00 51.96 51.67 2jtn s ALA 78 Cb -0.16 0.92 0.02 0.00 0.00 0.00 0.00 23.12 23.90 2jtn s ALA 78 CO 0.10 -0.83 0.46 1.28 0.00 0.00 0.00 175.76 176.76 2jtn n LEU 79 N -0.36 -2.26 -2.53 0.00 4.77 -1.26 -1.21 117.00 114.15 2jtn n LEU 79 Ca -0.06 -0.23 -0.19 0.00 -0.03 0.00 0.00 56.01 55.49 2jtn n LEU 79 Cb 0.62 -2.76 0.02 0.00 -2.33 0.00 0.00 43.42 38.98 2jtn n LEU 79 CO 0.19 0.13 -0.04 0.47 -1.33 0.00 0.00 177.39 176.81 2jtn n ASP 80 N -2.36 -5.48 -3.65 -1.43 8.00 -1.26 -4.95 116.55 105.41 2jtn n ASP 80 Ca -0.12 -0.21 -0.01 0.00 0.71 0.00 0.00 54.79 55.16 2jtn n ASP 80 Cb 0.62 -4.36 -0.00 0.00 -0.02 0.00 0.00 41.12 37.35 2jtn n ASP 80 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2jtn s ARG 81 N -5.43 0.87 -0.29 -1.24 0.52 -0.35 -5.13 118.95 107.89 2jtn s ARG 81 Ca 0.22 -0.50 -0.21 0.00 -0.52 0.00 0.00 55.73 54.72 2jtn s ARG 81 Cb -0.10 0.28 -0.01 0.00 0.52 0.00 0.00 34.95 35.65 2jtn s ARG 81 CO 0.27 -0.40 0.65 -3.38 0.02 0.00 0.00 175.30 172.46 2jtn s HIS 82 N -2.72 3.23 -0.17 -0.53 -3.43 -1.26 0.35 115.29 110.75 2jtn s HIS 82 Ca 0.16 0.66 -0.03 0.00 -0.80 0.00 0.00 55.06 55.05 2jtn s HIS 82 Cb 0.01 -2.98 -0.02 0.00 -1.43 0.00 0.00 32.58 28.16 2jtn s HIS 82 CO 0.00 -0.45 -0.06 -1.58 -2.00 0.00 0.00 174.74 170.65 2jtn s TRP 83 N 2.63 2.94 0.42 0.38 0.52 -0.67 -3.57 118.94 121.58 2jtn s TRP 83 Ca 0.26 -0.63 -0.24 0.00 0.02 0.00 0.00 56.10 55.51 2jtn s TRP 83 Cb -0.15 -1.99 -0.11 0.00 -1.15 0.00 0.00 33.47 30.08 2jtn s TRP 83 CO 0.11 -0.28 1.00 1.58 0.02 0.00 0.00 176.95 179.38 2jtn n HIS 84 N 4.03 1.15 -0.25 -1.98 -0.00 -1.25 -3.79 115.22 113.12 2jtn n HIS 84 Ca -0.18 0.56 0.05 0.00 0.46 0.00 0.00 57.72 58.61 2jtn n HIS 84 Cb 0.52 -2.22 0.29 0.00 -0.12 0.00 0.00 29.99 28.45 2jtn n HIS 84 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2jtn h SER 85 N 1.54 0.80 0.57 0.26 4.64 -1.89 -0.80 113.55 118.67 2jtn h SER 85 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2jtn h SER 85 Cb 1.34 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2jtn h SER 85 CO 0.57 0.52 -0.71 1.17 -0.87 0.00 0.00 176.83 177.51 2jtn n LYS 86 N -4.48 0.17 -0.79 4.77 0.00 -1.26 -3.89 118.16 112.67 2jtn n LYS 86 Ca 0.12 0.02 0.02 0.00 0.00 0.00 0.00 58.31 58.47 2jtn n LYS 86 Cb 0.20 -1.58 0.31 0.00 0.00 0.00 0.00 35.03 33.96 2jtn n LYS 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2jtn n LEU 88 N -0.19 3.07 -4.89 0.00 7.94 -0.57 -4.55 117.00 117.81 2jtn n LEU 88 Ca 0.31 -3.95 -0.30 0.00 -1.11 0.00 0.00 56.01 50.97 2jtn n LEU 88 Cb 1.16 -0.54 -0.04 0.00 0.53 0.00 0.00 43.42 44.53 2jtn n LEU 88 CO 0.30 1.43 0.26 -0.54 -1.11 0.00 0.00 177.39 177.73 2jtn s LYS 89 N -3.27 3.71 0.56 1.96 3.01 -1.26 -3.59 119.74 120.87 2jtn s LYS 89 Ca 0.40 0.18 -0.21 0.00 -1.01 0.00 0.00 55.97 55.33 2jtn s LYS 89 Cb 0.38 -2.59 -0.04 0.00 -1.01 0.00 0.00 37.83 34.56 2jtn s LYS 89 CO -0.05 0.20 1.32 0.00 0.51 0.00 0.00 175.35 177.32 2jtn h SER 91 N 1.23 0.00 0.00 0.00 0.87 -1.83 -1.74 113.55 112.08 2jtn h SER 91 Ca -0.51 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2jtn h SER 91 Cb 1.31 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 2jtn h SER 91 CO 0.56 0.37 -0.52 -0.67 -0.53 0.00 0.00 176.83 176.04 2jtn n ASP 92 N -3.87 1.21 0.21 6.23 2.03 -1.26 -4.61 116.55 116.48 2jtn n ASP 92 Ca -0.01 0.20 0.11 0.00 0.52 0.00 0.00 54.79 55.61 2jtn n ASP 92 Cb 0.43 -0.56 0.68 0.00 -0.72 0.00 0.00 41.12 40.95 2jtn n ASP 92 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jtn n HIS 94 N -4.42 -0.29 -3.11 0.00 -0.00 -0.65 -4.91 115.22 101.83 2jtn n HIS 94 Ca -0.00 0.00 -0.28 0.00 0.46 0.00 0.00 57.72 57.90 2jtn n HIS 94 Cb 0.20 -3.30 -0.02 0.00 -0.12 0.00 0.00 29.99 26.75 2jtn n HIS 94 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 2jtn s VAL 95 N -2.65 4.97 -0.16 3.57 -7.23 -1.26 -4.68 120.40 112.96 2jtn s VAL 95 Ca 0.00 0.11 -0.29 0.00 -1.81 0.00 0.00 61.98 59.98 2jtn s VAL 95 Cb 0.00 -3.78 -0.02 0.00 0.56 0.00 0.00 36.38 33.14 2jtn s VAL 95 CO 0.00 -0.50 1.38 -2.16 -0.31 0.00 0.00 175.10 173.51 2jtn s PRO 96 N -3.97 4.14 -1.06 4.82 0.04 -1.26 -2.53 135.00 135.18 2jtn s PRO 96 Ca 0.45 1.72 -0.04 0.00 0.04 0.00 0.00 61.00 63.17 2jtn s PRO 96 Cb -0.10 -3.85 0.30 0.00 0.04 0.00 0.00 34.50 30.88 2jtn s PRO 96 CO 0.34 -0.84 1.36 1.28 0.04 0.00 0.00 177.00 179.18 2jtn n LEU 97 N 7.01 6.07 -2.21 -3.56 4.32 -1.24 -4.79 117.00 122.61 2jtn n LEU 97 Ca 0.15 -5.19 -0.24 0.00 -0.02 0.00 0.00 56.01 50.71 2jtn n LEU 97 Cb 0.45 -1.28 0.17 0.00 -1.62 0.00 0.00 43.42 41.14 2jtn n LEU 97 CO 0.59 1.64 1.28 0.00 -1.22 0.00 0.00 177.39 179.68 2jtn n ALA 98 N 1.58 5.58 0.00 -1.18 0.00 -1.26 -4.40 120.51 120.82 2jtn n ALA 98 Ca 0.26 -2.86 0.00 0.00 0.00 0.00 0.00 53.44 50.84 2jtn n ALA 98 Cb 0.35 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.34 2jtn n ALA 98 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jtn n GLU 99 N -1.09 0.00 -4.03 0.00 -0.58 -1.26 -5.04 120.64 108.63 2jtn n GLU 99 Ca 0.59 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 57.25 2jtn n GLU 99 Cb 1.59 -0.09 -0.10 0.00 -0.57 0.00 0.00 31.44 32.28 2jtn n GLU 99 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2jtn s ARG 100 N -1.74 0.61 0.29 3.49 1.04 -1.26 -3.80 118.95 117.57 2jtn s ARG 100 Ca 0.00 -1.07 0.02 0.00 -1.04 0.00 0.00 55.73 53.64 2jtn s ARG 100 Cb 0.00 0.22 -0.03 0.00 -2.04 0.00 0.00 34.95 33.10 2jtn s ARG 100 CO 0.00 -0.13 0.28 0.00 -0.04 0.00 0.00 175.30 175.41 2jtn s PHE 102 N -3.62 -0.55 -0.02 0.00 2.19 0.30 -4.62 117.98 111.66 2jtn s PHE 102 Ca 0.38 0.83 0.02 0.00 0.33 0.00 0.00 56.93 58.48 2jtn s PHE 102 Cb 0.03 0.45 0.01 0.00 -1.31 0.00 0.00 43.02 42.20 2jtn s PHE 102 CO 0.21 -0.57 -0.06 0.45 1.83 0.00 0.00 175.22 177.08 2jtn s SER 103 N -1.48 0.91 -0.14 6.13 0.15 -1.26 0.10 113.70 118.12 2jtn s SER 103 Ca -0.06 -0.13 -0.06 0.00 0.70 0.00 0.00 55.95 56.40 2jtn s SER 103 Cb -0.00 -0.28 0.06 0.00 -1.71 0.00 0.00 66.02 64.09 2jtn s SER 103 CO 0.03 0.02 0.29 -0.13 1.20 0.00 0.00 173.24 174.66 2jtn s ARG 104 N 0.34 0.21 0.00 5.44 1.81 -1.19 -4.89 118.95 120.67 2jtn s ARG 104 Ca -0.04 0.73 0.00 0.00 -1.72 0.00 0.00 55.73 54.69 2jtn s ARG 104 Cb -0.09 -0.01 0.00 0.00 -0.45 0.00 0.00 34.95 34.40 2jtn s ARG 104 CO 0.00 -0.23 0.00 0.41 -0.68 0.00 0.00 175.30 174.80 2jtn n GLY 105 N 4.91 1.12 0.68 -3.53 0.00 -1.26 -3.27 105.19 103.84 2jtn n GLY 105 Ca -0.14 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2jtn n GLY 105 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jtn n GLU 106 N 0.00 0.00 -0.91 1.61 1.02 -1.26 -5.15 120.64 115.95 2jtn n GLU 106 Ca 0.00 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.83 2jtn n GLU 106 Cb 0.00 0.00 0.26 0.00 -0.02 0.00 0.00 31.44 31.68 2jtn n GLU 106 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2jtn s SER 107 N -1.50 0.12 -0.21 1.62 1.04 -1.20 -5.02 113.70 108.54 2jtn s SER 107 Ca 0.00 0.55 -0.06 0.00 0.48 0.00 0.00 55.95 56.93 2jtn s SER 107 Cb 0.00 -0.72 -0.02 0.00 0.10 0.00 0.00 66.02 65.38 2jtn s SER 107 CO 0.00 -4.61 0.01 0.54 0.98 0.00 0.00 173.24 170.17 2jtn s VAL 108 N -2.86 3.99 0.41 5.02 0.11 -1.26 -3.18 120.40 122.62 2jtn s VAL 108 Ca 0.72 -0.29 0.07 0.00 -2.93 0.00 0.00 61.98 59.55 2jtn s VAL 108 Cb -0.08 -2.82 -0.05 0.00 -1.53 0.00 0.00 36.38 31.89 2jtn s VAL 108 CO 0.56 0.41 0.16 -0.31 -3.33 0.00 0.00 175.10 172.58 2jtn s TYR 109 N 1.20 2.60 0.37 1.54 1.51 0.28 -2.20 117.35 122.65 2jtn s TYR 109 Ca 0.03 -0.58 0.07 0.00 -1.01 0.00 0.00 57.07 55.59 2jtn s TYR 109 Cb -0.14 -1.91 -0.07 0.00 -0.11 0.00 0.00 41.96 39.72 2jtn s TYR 109 CO 0.02 0.23 -0.02 0.00 -1.11 0.00 0.00 175.55 174.67 2jtn h LYS 111 N 1.94 0.00 -0.29 0.00 1.57 -1.89 -2.84 116.57 115.06 2jtn h LYS 111 Ca -0.43 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.41 2jtn h LYS 111 Cb 1.24 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.50 2jtn h LYS 111 CO 0.75 0.61 -0.05 0.22 -0.57 0.00 0.00 179.45 180.41 2jtn h ASP 112 N 0.00 -0.23 1.56 0.86 3.58 -1.97 -2.12 116.42 118.10 2jtn h ASP 112 Ca -0.01 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 2jtn h ASP 112 Cb 1.38 0.16 -0.00 0.00 1.72 0.00 0.00 39.33 42.59 2jtn h ASP 112 CO 0.08 -0.08 -0.44 -2.24 -2.88 0.00 0.00 179.24 173.68 2jtn h ASP 113 N 0.02 0.00 0.02 2.28 3.04 -2.00 -3.30 116.42 116.48 2jtn h ASP 113 Ca 0.14 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.91 2jtn h ASP 113 Cb 0.20 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.49 2jtn h ASP 113 CO -0.28 0.05 -0.04 0.15 -2.04 0.00 0.00 179.24 177.08 2jtn h PHE 114 N 0.00 0.06 -0.17 4.15 3.04 -1.14 0.97 116.94 123.85 2jtn h PHE 114 Ca -0.01 -0.00 -0.06 0.00 3.98 0.00 0.00 57.97 61.88 2jtn h PHE 114 Cb 1.05 -0.02 -0.00 0.00 2.56 0.00 0.00 35.95 39.53 2jtn h PHE 114 CO 0.00 0.11 -0.13 0.74 -2.02 0.00 0.00 178.31 177.01 2jtn h PHE 115 N 0.06 0.46 0.00 0.41 0.04 -1.56 1.05 116.94 117.40 2jtn h PHE 115 Ca 0.02 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.66 2jtn h PHE 115 Cb 0.12 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.17 2jtn h PHE 115 CO 0.00 0.74 -0.25 0.87 -0.60 0.00 0.00 178.31 179.07 2jtn h LYS 116 N 0.05 0.00 0.24 1.51 1.57 -1.62 -2.42 116.57 115.90 2jtn h LYS 116 Ca 0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2jtn h LYS 116 Cb 0.64 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.95 2jtn h LYS 116 CO 0.03 0.00 -0.15 0.00 -0.57 0.00 0.00 179.45 178.77 2jtn h ARG 117 N -0.92 -0.36 0.14 3.15 2.47 0.78 -3.31 114.38 116.33 2jtn h ARG 117 Ca 0.00 0.02 -0.27 0.00 -1.26 0.00 0.00 59.98 58.47 2jtn h ARG 117 Cb 0.25 0.08 0.01 0.00 -1.65 0.00 0.00 29.97 28.66 2jtn h ARG 117 CO 0.00 -0.24 -1.35 0.74 0.56 0.00 0.00 179.97 179.68 2jtn h PHE 118 N -0.37 0.55 0.00 3.04 -1.00 -1.32 -3.46 116.94 114.37 2jtn h PHE 118 Ca -0.02 -0.40 0.00 0.00 2.81 0.00 0.00 57.97 60.36 2jtn h PHE 118 Cb 0.31 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 39.85 2jtn h PHE 118 CO -0.09 1.53 0.00 0.41 -1.61 0.00 0.00 178.31 178.55 2jtn n GLY 119 N 1.74 -2.54 3.86 -1.45 0.00 0.36 -4.97 105.19 102.18 2jtn n GLY 119 Ca -0.22 -0.78 -0.27 0.00 0.00 0.00 0.00 46.02 44.74 2jtn n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jtn s THR 120 N 0.00 4.88 0.15 2.61 2.01 -1.15 -4.89 115.64 119.25 2jtn s THR 120 Ca 0.00 -0.84 -0.15 0.00 0.31 0.00 0.00 61.69 61.01 2jtn s THR 120 Cb 0.00 -3.48 0.02 0.00 0.01 0.00 0.00 72.50 69.06 2jtn s THR 120 CO 0.00 -0.06 0.40 -1.59 -0.69 0.00 0.00 174.62 172.69 2jtn s LYS 121 N -3.02 1.16 0.35 4.92 0.00 -1.26 -3.03 119.74 118.85 2jtn s LYS 121 Ca 0.32 -0.85 -0.28 0.00 0.00 0.00 0.00 55.97 55.16 2jtn s LYS 121 Cb -0.11 0.46 -0.12 0.00 0.00 0.00 0.00 37.83 38.06 2jtn s LYS 121 CO 0.26 -0.46 1.39 0.00 0.00 0.00 0.00 175.35 176.54 2jtn n ALA 123 N 0.60 5.03 0.06 0.00 0.00 -1.24 -2.99 120.51 121.97 2jtn n ALA 123 Ca 0.04 -2.38 0.00 0.00 0.00 0.00 0.00 53.44 51.10 2jtn n ALA 123 Cb 0.37 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.46 2jtn n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn n ALA 124 N -0.80 3.00 -0.26 0.00 0.00 -1.26 -4.85 120.51 116.34 2jtn n ALA 124 Ca 0.49 0.00 0.07 0.00 0.00 0.00 0.00 53.44 54.00 2jtn n ALA 124 Cb 1.46 0.22 0.21 0.00 0.00 0.00 0.00 19.45 21.34 2jtn n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn n GLN 126 N 0.81 -4.86 -3.83 0.00 3.00 -1.16 -4.96 117.38 106.38 2jtn n GLN 126 Ca 0.16 0.75 -0.37 0.00 -0.01 0.00 0.00 57.00 57.53 2jtn n GLN 126 Cb 0.50 -5.59 -0.07 0.00 0.00 0.00 0.00 30.24 25.09 2jtn n GLN 126 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 2jtn s LEU 127 N -6.76 4.35 0.19 1.08 2.96 -1.25 -4.85 118.68 114.40 2jtn s LEU 127 Ca 0.40 0.43 -0.31 0.00 -0.22 0.00 0.00 54.13 54.42 2jtn s LEU 127 Cb -0.19 -2.10 -0.10 0.00 0.50 0.00 0.00 46.19 44.31 2jtn s LEU 127 CO 0.49 0.35 1.51 -0.83 -1.32 0.00 0.00 176.35 176.55 2jtn s GLY 128 N -0.67 1.86 -0.17 7.98 0.00 -1.26 0.72 107.32 115.77 2jtn s GLY 128 Ca 0.14 1.34 -0.15 0.00 0.00 0.00 0.00 44.72 46.05 2jtn s GLY 128 CO 0.03 2.49 0.35 -0.42 0.00 0.00 0.00 173.10 175.55 2jtn s ILE 129 N 0.74 5.26 1.02 0.90 1.01 -1.17 -4.81 121.20 124.15 2jtn s ILE 129 Ca 0.66 0.64 -0.24 0.00 0.00 0.00 0.00 60.65 61.71 2jtn s ILE 129 Cb -0.43 -3.69 -0.13 0.00 0.01 0.00 0.00 42.46 38.23 2jtn s ILE 129 CO 0.35 0.33 -1.10 -2.65 0.00 0.00 0.00 174.94 171.87 2jtn n PRO 130 N 3.93 -0.32 0.21 2.79 -0.02 -1.26 -4.80 135.00 135.52 2jtn n PRO 130 Ca -0.10 -0.09 -0.14 0.00 -2.02 0.00 0.00 63.50 61.15 2jtn n PRO 130 Cb 0.52 -1.16 -0.08 0.00 -0.02 0.00 0.00 33.50 32.75 2jtn n PRO 130 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2jtn h PRO 131 N -1.22 -0.51 0.00 0.52 0.11 -1.96 -3.38 132.00 125.56 2jtn h PRO 131 Ca -0.43 0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 2jtn h PRO 131 Cb 1.38 0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.59 2jtn h PRO 131 CO 0.25 -0.22 -0.21 2.41 -0.21 0.00 0.00 178.00 180.02 2jtn n THR 132 N -5.21 1.40 -1.81 -1.15 -1.04 -1.26 0.12 114.28 105.32 2jtn n THR 132 Ca -0.10 -1.79 -0.41 0.00 -2.04 0.00 0.00 64.05 59.70 2jtn n THR 132 Cb 0.28 -0.02 -0.01 0.00 -1.82 0.00 0.00 70.33 68.76 2jtn n THR 132 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jtn s GLN 133 N -2.12 4.13 -0.41 -2.82 1.03 -1.26 -4.67 119.66 113.54 2jtn s GLN 133 Ca 0.25 2.55 -0.28 0.00 0.04 0.00 0.00 55.36 57.91 2jtn s GLN 133 Cb 0.23 -3.01 -0.00 0.00 0.03 0.00 0.00 33.01 30.25 2jtn s GLN 133 CO 0.00 -0.57 1.60 0.08 -2.54 0.00 0.00 175.29 173.87 2jtn s VAL 134 N -0.42 3.68 0.07 3.63 1.01 -1.26 -4.02 120.40 123.09 2jtn s VAL 134 Ca 0.59 0.66 -0.06 0.00 0.00 0.00 0.00 61.98 63.17 2jtn s VAL 134 Cb -0.47 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 31.92 2jtn s VAL 134 CO 0.53 -0.67 0.12 0.54 0.00 0.00 0.00 175.10 175.62 2jtn s VAL 135 N 6.35 0.16 -0.10 2.92 0.11 -1.24 -4.78 120.40 123.82 2jtn s VAL 135 Ca 0.68 -1.33 -0.12 0.00 -2.93 0.00 0.00 61.98 58.29 2jtn s VAL 135 Cb -0.17 -1.33 -0.05 0.00 -1.53 0.00 0.00 36.38 33.30 2jtn s VAL 135 CO 0.31 -0.73 0.27 0.00 -3.33 0.00 0.00 175.10 171.62 2jtn s ARG 136 N -3.71 3.89 0.32 1.54 3.03 -1.26 0.13 118.95 122.89 2jtn s ARG 136 Ca 0.04 0.10 0.08 0.00 2.03 0.00 0.00 55.73 57.98 2jtn s ARG 136 Cb 0.05 -3.29 -0.03 0.00 -1.03 0.00 0.00 34.95 30.65 2jtn s ARG 136 CO -0.10 0.55 0.23 1.03 -1.13 0.00 0.00 175.30 175.88 2jtn s ARG 137 N -0.48 2.62 -0.56 3.89 0.52 -1.26 -3.18 118.95 120.50 2jtn s ARG 137 Ca 0.18 -1.35 -0.09 0.00 -0.52 0.00 0.00 55.73 53.95 2jtn s ARG 137 Cb -0.14 -2.38 0.14 0.00 0.52 0.00 0.00 34.95 33.09 2jtn s ARG 137 CO 0.06 0.14 0.44 0.00 0.02 0.00 0.00 175.30 175.97 2jtn s ALA 138 N -2.32 3.55 0.00 2.13 0.00 0.33 -4.87 121.76 120.58 2jtn s ALA 138 Ca 0.39 -2.79 0.00 0.00 0.00 0.00 0.00 51.96 49.55 2jtn s ALA 138 Cb -0.05 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.14 2jtn s ALA 138 CO 0.25 -2.01 0.00 1.04 0.00 0.00 0.00 175.76 175.04 2jtn n GLN 139 N 4.52 0.00 -0.13 0.00 6.02 -1.26 -1.77 117.38 124.75 2jtn n GLN 139 Ca -0.02 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.70 2jtn n GLN 139 Cb 0.41 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.57 2jtn n GLN 139 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2jtn n ASP 140 N 2.08 1.88 -4.90 1.08 2.03 -1.26 -5.01 116.55 112.45 2jtn n ASP 140 Ca 0.00 0.29 -0.29 0.00 0.52 0.00 0.00 54.79 55.31 2jtn n ASP 140 Cb 0.00 -0.75 0.01 0.00 -0.72 0.00 0.00 41.12 39.66 2jtn n ASP 140 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2jtn s PHE 141 N -2.49 3.51 0.11 -0.67 0.08 -0.73 -5.09 117.98 112.70 2jtn s PHE 141 Ca -0.37 0.95 0.03 0.00 0.12 0.00 0.00 56.93 57.66 2jtn s PHE 141 Cb 0.14 -2.58 -0.04 0.00 -0.57 0.00 0.00 43.02 39.97 2jtn s PHE 141 CO 0.47 -0.58 0.15 0.54 -0.10 0.00 0.00 175.22 175.70 2jtn s VAL 142 N -2.98 4.77 0.39 -0.44 0.11 -1.26 0.12 120.40 121.11 2jtn s VAL 142 Ca 0.52 -0.79 0.03 0.00 -2.93 0.00 0.00 61.98 58.81 2jtn s VAL 142 Cb -0.11 -3.37 -0.04 0.00 -1.53 0.00 0.00 36.38 31.34 2jtn s VAL 142 CO 0.48 0.03 0.09 -0.31 -3.33 0.00 0.00 175.10 172.06 2jtn s TYR 143 N -1.57 1.85 0.63 1.54 1.51 -1.19 -3.60 117.35 116.53 2jtn s TYR 143 Ca 0.31 -1.14 -0.09 0.00 -1.01 0.00 0.00 57.07 55.14 2jtn s TYR 143 Cb -0.11 -1.24 -0.00 0.00 -0.11 0.00 0.00 41.96 40.50 2jtn s TYR 143 CO 0.24 -0.15 0.99 -1.58 -1.11 0.00 0.00 175.55 173.95 2jtn s HIS 144 N -3.22 3.38 0.09 2.71 2.46 -1.26 -4.59 115.29 114.85 2jtn s HIS 144 Ca 0.27 0.93 0.04 0.00 0.47 0.00 0.00 55.06 56.77 2jtn s HIS 144 Cb 0.05 -2.82 -0.24 0.00 -0.13 0.00 0.00 32.58 29.44 2jtn s HIS 144 CO 0.14 -0.89 1.16 -0.07 -2.47 0.00 0.00 174.74 172.61 2jtn h LEU 145 N -0.35 0.14 0.01 8.88 4.07 -1.95 -3.11 115.31 122.99 2jtn h LEU 145 Ca -0.45 -0.16 -0.27 0.00 0.08 0.00 0.00 57.88 57.08 2jtn h LEU 145 Cb 1.24 -0.04 -0.04 0.00 1.08 0.00 0.00 40.66 42.90 2jtn h LEU 145 CO 0.62 1.13 -1.47 1.41 -1.08 0.00 0.00 178.44 179.05 2jtn n HIS 146 N -3.38 0.91 -0.17 1.13 8.25 -1.26 -4.20 115.22 116.51 2jtn n HIS 146 Ca -0.05 0.38 0.22 0.00 -0.26 0.00 0.00 57.72 58.01 2jtn n HIS 146 Cb 0.98 -1.09 0.61 0.00 1.12 0.00 0.00 29.99 31.61 2jtn n HIS 146 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jtn n PHE 148 N -4.40 2.40 -3.85 0.00 7.35 -1.18 -4.89 117.46 112.88 2jtn n PHE 148 Ca 0.17 -0.16 -0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2jtn n PHE 148 Cb 0.75 -2.72 0.01 0.00 0.35 0.00 0.00 39.48 37.86 2jtn n PHE 148 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jtn n ALA 149 N 7.11 -2.21 -2.88 3.13 0.00 -1.26 -3.54 120.51 120.86 2jtn n ALA 149 Ca 0.22 -0.66 -0.31 0.00 0.00 0.00 0.00 53.44 52.69 2jtn n ALA 149 Cb 0.34 0.27 -0.05 0.00 0.00 0.00 0.00 19.45 20.02 2jtn n ALA 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn h VAL 151 N 2.20 0.90 0.00 0.00 -1.51 -1.84 -0.79 116.25 115.22 2jtn h VAL 151 Ca -0.45 -1.18 -0.11 0.00 -1.23 0.00 0.00 66.70 63.73 2jtn h VAL 151 Cb 1.16 1.70 -0.02 0.00 -2.13 0.00 0.00 31.29 32.00 2jtn h VAL 151 CO 0.73 0.30 -1.14 0.52 -1.23 0.00 0.00 177.57 176.75 2jtn n VAL 152 N -3.73 1.26 0.22 7.19 0.31 -1.26 -4.63 118.33 117.70 2jtn n VAL 152 Ca -0.01 0.06 0.07 0.00 -0.01 0.00 0.00 64.34 64.44 2jtn n VAL 152 Cb 0.40 -1.96 0.51 0.00 -0.91 0.00 0.00 33.84 31.88 2jtn n VAL 152 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jtn n LYS 154 N -3.98 -4.51 -4.71 0.00 4.81 -0.30 -4.87 118.16 104.60 2jtn n LYS 154 Ca -0.02 0.85 -0.24 0.00 -0.87 0.00 0.00 58.31 58.02 2jtn n LYS 154 Cb 0.31 -5.68 -0.15 0.00 0.02 0.00 0.00 35.03 29.54 2jtn n LYS 154 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 2jtn s ARG 155 N -5.71 1.34 0.72 1.64 1.70 -1.26 -4.67 118.95 112.70 2jtn s ARG 155 Ca 0.30 -0.74 -0.16 0.00 -0.47 0.00 0.00 55.73 54.66 2jtn s ARG 155 Cb -0.14 -1.35 0.02 0.00 -0.57 0.00 0.00 34.95 32.91 2jtn s ARG 155 CO 0.37 0.36 1.13 1.04 -1.08 0.00 0.00 175.30 177.12 2jtn n GLN 156 N 2.29 0.62 -3.73 3.89 6.02 -1.23 -1.99 117.38 123.25 2jtn n GLN 156 Ca -0.16 0.27 -0.38 0.00 -0.01 0.00 0.00 57.00 56.72 2jtn n GLN 156 Cb 0.54 -2.37 -0.12 0.00 1.02 0.00 0.00 30.24 29.31 2jtn n GLN 156 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2jtn s LEU 157 N -4.13 4.57 0.55 1.08 2.01 -1.26 -4.90 118.68 116.60 2jtn s LEU 157 Ca 0.76 -1.31 -0.01 0.00 0.01 0.00 0.00 54.13 53.59 2jtn s LEU 157 Cb -0.34 -1.88 0.03 0.00 0.01 0.00 0.00 46.19 44.00 2jtn s LEU 157 CO 0.47 -0.39 0.80 0.00 1.01 0.00 0.00 176.35 178.24 2jtn s ALA 158 N 1.38 3.68 0.05 4.21 0.00 -1.26 -4.89 121.76 124.94 2jtn s ALA 158 Ca 0.00 -1.13 -0.37 0.00 0.00 0.00 0.00 51.96 50.46 2jtn s ALA 158 Cb -0.21 -2.23 -0.19 0.00 0.00 0.00 0.00 23.12 20.49 2jtn s ALA 158 CO 0.02 -0.75 0.97 2.41 0.00 0.00 0.00 175.76 178.41 2jtn n THR 159 N -2.39 0.47 0.00 0.00 -1.04 -1.26 -0.57 114.28 109.49 2jtn n THR 159 Ca 0.06 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 2jtn n THR 159 Cb 0.59 -0.07 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 2jtn n THR 159 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jtn n GLY 160 N 1.67 3.03 3.71 3.41 0.00 0.19 -4.89 105.19 112.31 2jtn n GLY 160 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2jtn n GLY 160 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jtn s ASP 161 N 0.22 6.75 -0.36 1.61 -1.08 0.27 -4.67 116.67 119.42 2jtn s ASP 161 Ca 0.00 2.38 -0.23 0.00 -0.52 0.00 0.00 52.55 54.18 2jtn s ASP 161 Cb 0.00 -2.58 0.01 0.00 -1.46 0.00 0.00 42.92 38.89 2jtn s ASP 161 CO 0.00 -0.72 0.76 -1.61 0.52 0.00 0.00 175.17 174.12 2jtn s GLU 162 N 1.42 3.74 0.02 4.34 2.02 -1.26 0.95 118.70 129.94 2jtn s GLU 162 Ca 0.67 0.27 0.05 0.00 0.02 0.00 0.00 54.97 55.98 2jtn s GLU 162 Cb -0.38 -3.81 -0.02 0.00 0.10 0.00 0.00 34.13 30.02 2jtn s GLU 162 CO 0.30 -0.83 -0.16 -0.59 0.02 0.00 0.00 175.26 174.00 2jtn s PHE 163 N 3.03 1.41 0.28 1.61 -0.71 -1.14 -3.71 117.98 118.76 2jtn s PHE 163 Ca 0.30 -0.33 0.06 0.00 -1.04 0.00 0.00 56.93 55.92 2jtn s PHE 163 Cb -0.13 -0.86 -0.02 0.00 -1.21 0.00 0.00 43.02 40.79 2jtn s PHE 163 CO 0.16 0.03 0.41 0.71 -1.34 0.00 0.00 175.22 175.19 2jtn s TYR 164 N -0.67 3.29 -0.29 3.49 2.02 0.30 -3.77 117.35 121.72 2jtn s TYR 164 Ca 0.04 -0.11 -0.02 0.00 -0.37 0.00 0.00 57.07 56.61 2jtn s TYR 164 Cb -0.07 -1.76 0.05 0.00 -0.40 0.00 0.00 41.96 39.77 2jtn s TYR 164 CO 0.01 0.23 -0.02 -1.17 -1.57 0.00 0.00 175.55 173.03 2jtn s LEU 165 N -4.07 3.75 0.78 -1.29 2.96 -1.26 -2.15 118.68 117.42 2jtn s LEU 165 Ca 0.39 -1.21 -0.11 0.00 -0.22 0.00 0.00 54.13 52.98 2jtn s LEU 165 Cb -0.09 -1.70 0.06 0.00 0.50 0.00 0.00 46.19 44.96 2jtn s LEU 165 CO 0.30 -0.23 1.09 -0.04 -1.32 0.00 0.00 176.35 176.15 2jtn s MET 166 N 1.26 2.20 0.58 1.98 -1.94 0.63 -4.86 119.30 119.15 2jtn s MET 166 Ca -0.05 0.64 0.27 0.00 -1.71 0.00 0.00 55.69 54.85 2jtn s MET 166 Cb -0.19 -1.93 1.69 0.00 2.01 0.00 0.00 34.83 36.40 2jtn s MET 166 CO -0.02 -1.54 2.20 0.93 -0.01 0.00 0.00 175.02 176.58 2jtn h GLU 167 N -1.03 0.00 -0.90 2.03 3.07 -1.96 -0.28 114.58 115.51 2jtn h GLU 167 Ca -0.47 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 58.09 2jtn h GLU 167 Cb 1.26 0.00 -0.18 0.00 -0.84 0.00 0.00 28.75 28.99 2jtn h GLU 167 CO 0.59 0.00 0.39 -0.25 -1.40 0.00 0.00 179.01 178.35 2jtn n ASP 168 N -3.97 4.03 -3.62 1.42 9.92 -1.26 -4.89 116.55 118.18 2jtn n ASP 168 Ca -0.02 -3.18 -0.22 0.00 -0.53 0.00 0.00 54.79 50.84 2jtn n ASP 168 Cb 0.15 -0.75 0.06 0.00 -0.64 0.00 0.00 41.12 39.94 2jtn n ASP 168 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2jtn n SER 169 N -0.47 -2.93 -4.61 -2.24 7.64 -0.12 -4.99 113.62 105.90 2jtn n SER 169 Ca 0.42 -0.70 -0.31 0.00 1.01 0.00 0.00 58.87 59.30 2jtn n SER 169 Cb 1.36 -4.58 -0.10 0.00 -1.01 0.00 0.00 64.21 59.89 2jtn n SER 169 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2jtn s ARG 170 N -5.92 2.46 -0.19 1.43 6.06 -1.24 -4.86 118.95 116.69 2jtn s ARG 170 Ca 0.20 -0.81 -0.12 0.00 -2.50 0.00 0.00 55.73 52.51 2jtn s ARG 170 Cb -0.10 -2.47 -0.05 0.00 0.06 0.00 0.00 34.95 32.40 2jtn s ARG 170 CO 0.77 0.57 0.21 -0.51 -2.50 0.00 0.00 175.30 173.84 2jtn s LEU 171 N -1.76 4.20 -0.09 -0.88 1.02 -1.26 -0.27 118.68 119.65 2jtn s LEU 171 Ca 0.20 0.32 -0.04 0.00 0.02 0.00 0.00 54.13 54.63 2jtn s LEU 171 Cb -0.11 -2.22 0.04 0.00 0.02 0.00 0.00 46.19 43.92 2jtn s LEU 171 CO 0.11 0.12 0.20 0.54 0.02 0.00 0.00 176.35 177.33 2jtn s VAL 172 N 0.58 -0.04 1.09 -1.59 0.11 -0.91 -2.28 120.40 117.35 2jtn s VAL 172 Ca 0.12 0.16 -0.15 0.00 -2.93 0.00 0.00 61.98 59.17 2jtn s VAL 172 Cb -0.12 -0.31 0.24 0.00 -1.53 0.00 0.00 36.38 34.66 2jtn s VAL 172 CO 0.02 0.07 0.54 0.00 -3.33 0.00 0.00 175.10 172.39 2jtn h LYS 174 N 0.00 -0.71 -0.09 0.00 1.63 -1.95 -2.61 116.57 112.84 2jtn h LYS 174 Ca -0.25 0.05 -0.06 0.00 -0.85 0.00 0.00 60.65 59.54 2jtn h LYS 174 Cb 0.83 0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.61 2jtn h LYS 174 CO 0.15 -0.48 -0.23 0.00 -3.45 0.00 0.00 179.45 175.45 2jtn h ALA 175 N -1.30 1.46 0.00 5.00 0.00 -1.94 -2.20 119.26 120.27 2jtn h ALA 175 Ca -0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 2jtn h ALA 175 Cb 0.57 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2jtn h ALA 175 CO 0.12 0.39 -0.12 -0.44 0.00 0.00 0.00 179.25 179.20 2jtn h ASP 176 N 0.14 0.00 0.21 0.00 5.19 -1.90 -3.13 116.42 116.93 2jtn h ASP 176 Ca 0.02 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.43 2jtn h ASP 176 Cb 0.48 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.99 2jtn h ASP 176 CO 0.03 0.12 -0.20 0.22 -3.12 0.00 0.00 179.24 176.29 2jtn h TYR 177 N 0.00 -0.57 -0.40 4.55 5.03 -0.99 0.28 116.97 124.87 2jtn h TYR 177 Ca -0.00 0.00 0.12 0.00 2.58 0.00 0.00 58.73 61.43 2jtn h TYR 177 Cb 0.28 0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.76 2jtn h TYR 177 CO 0.00 -0.27 0.39 0.93 -1.32 0.00 0.00 178.16 177.89 2jtn h GLU 178 N -0.41 0.00 0.00 1.82 4.39 -1.69 0.97 114.58 119.66 2jtn h GLU 178 Ca -0.03 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.48 2jtn h GLU 178 Cb 0.36 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 2jtn h GLU 178 CO -0.02 0.00 -0.93 1.15 -1.16 0.00 0.00 179.01 178.05 2jtn h THR 179 N 0.00 1.66 0.00 1.13 2.02 -1.32 -3.30 112.91 113.10 2jtn h THR 179 Ca 0.19 -3.16 -0.23 0.00 0.77 0.00 0.00 66.41 63.98 2jtn h THR 179 Cb 0.97 2.71 -0.04 0.00 -1.74 0.00 0.00 68.15 70.05 2jtn h THR 179 CO -0.00 0.90 -1.80 0.00 0.37 0.00 0.00 175.52 175.00 2jtn n ALA 180 N -2.37 1.81 -1.23 6.16 0.00 0.91 -5.09 120.51 120.70 2jtn n ALA 180 Ca -0.00 -0.80 0.16 0.00 0.00 0.00 0.00 53.44 52.80 2jtn n ALA 180 Cb 0.88 -0.71 -0.05 0.00 0.00 0.00 0.00 19.45 19.57 2jtn n ALA 180 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jtn n LYS 181 N -2.82 -2.61 0.00 0.00 4.76 0.30 -5.08 118.16 112.70 2jtn n LYS 181 Ca -0.17 1.88 0.12 0.00 -2.87 0.00 0.00 58.31 57.27 2jtn n LYS 181 Cb 0.94 -3.14 0.10 0.00 -1.84 0.00 0.00 35.03 31.09 2jtn n LYS 181 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07